2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide

C14H26N2O2 — CID 55117010

IUPAC2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide
SMILESCC1CCCC(C(=O)NCCC2CCCO2)C1N
InChIInChI=1S/C14H26N2O2/c1-10-4-2-6-12(13(10)15)14(17)16-8-7-11-5-3-9-18-11/h10-13H,2-9,15H2,1H3,(H,16,17)
InChIKeyVZVIGKSRKLEHMM-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.44
Rot. Bonds4

About 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide

2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide (PubChem CID 55117010) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide
PubChem CID55117010
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide
SMILESCC1CCCC(C(=O)NCCC2CCCO2)C1N
InChIInChI=1S/C14H26N2O2/c1-10-4-2-6-12(13(10)15)14(17)16-8-7-11-5-3-9-18-11/h10-13H,2-9,15H2,1H3,(H,16,17)
InChIKeyVZVIGKSRKLEHMM-UHFFFAOYSA-N
XLogP1.44
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-2-methyl-N-[2-(oxan-2-yl)ethyl]cyclohexane-1-carboxamide
CID 106000870
4-methyl-N-[2-(oxan-2-yl)ethyl]pyrrolidine-3-carboxamide
CID 114136026
2-amino-3-methyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexane-1-carboxamide
CID 79071178
3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide
CID 66008154
2-[2-(oxolan-2-yl)ethylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 64815766
2,2-dimethyl-3-[2-(oxolan-2-yl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 64835996
2-amino-3-methyl-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 62776500
methyl N-[2-(oxolan-2-yl)ethyl]carbamate
CID 110731266
4-[2-(oxolan-2-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63782308
5-methyl-N-[2-(oxolan-2-yl)ethyl]piperazine-2-carboxamide
CID 63103322
2-amino-N,3-dimethylcyclohexane-1-carboxamide
CID 62776522
2-amino-N-(oxolan-2-ylmethyl)cyclopropane-1-carboxamide
CID 114995836

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide (CID 55117010) is 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide is CC1CCCC(C(=O)NCCC2CCCO2)C1N.
What is the InChIKey of 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide?
The InChIKey is VZVIGKSRKLEHMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-10-4-2-6-12(13(10)15)14(17)16-8-7-11-5-3-9-18-11/h10-13H,2-9,15H2,1H3,(H,16,17).
What are the key properties of 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide?
2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 55117010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).